%chk=000080228.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080228

0 1
 Br  -2.537200       2.670200     -0.1435000    
 C  -8.3999999E-02  -1.645400      0.7060000    
 C    1.107200      -1.664600     -0.2616000    
 C   -1.332500      -1.004300      0.1275000    
 C    1.501400     -0.2852000     -0.7149000    
 C    2.373000      0.5630000     -0.1367000    
 C   -1.908900      -1.695700      -1.077200    
 C   -1.850000      9.8200001E-02  0.7043000    
 C    2.721800       1.932800     -0.6450000    
 C    3.080600      0.1762000       1.134800    
 C   -3.071500      0.8546000      0.3064000    
 H  -0.3242000      -2.677900      0.9904000    
 H   0.2160000      -1.144400       1.635600    
 H    1.951500      -2.183100      0.2059000    
 H   0.8684000      -2.264100      -1.148900    
 H    1.007100      5.1600002E-02  -1.625500    
 H   -2.926100      -1.376300      -1.313400    
 H   -1.288700      -1.511900      -1.959800    
 H   -1.954900      -2.776700     -0.9060000    
 H   -1.345000      0.4894000       1.587700    
 H    2.186500       2.166000      -1.571400    
 H    2.456900       2.694800      9.4999999E-02
 H    3.794500       2.001700     -0.8518000    
 H    4.154400      7.1699999E-02  0.9464000    
 H    2.730200     -0.7537000       1.587200    
 H    2.942500      0.9591000       1.889100    
 H   -3.590800      0.4667000     -0.5698000    
 H   -3.774900      0.9281000       1.139700    


%chk=000080228-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080228

0 1
Br -2.796657 2.357848 -1.188218
C -0.300590 -1.617767 0.842016
C 1.025779 -1.490689 0.015683
C -1.524607 -1.048123 0.138119
C 1.403674 -0.053364 -0.276955
C 2.568746 0.588851 0.029421
C -1.980695 -1.790639 -1.101598
C -2.128344 0.084361 0.622791
C 2.768677 2.049288 -0.347518
C 3.751311 -0.044156 0.742841
C -3.326845 0.751775 0.062368
H -0.468225 -2.695750 1.048156
H -0.155758 -1.112848 1.814861
H 1.825550 -2.009486 0.574588
H 0.904742 -2.048109 -0.936659
H 0.627400 0.530546 -0.795330
H -2.884983 -1.362143 -1.561663
H -1.185424 -1.779028 -1.871878
H -2.178959 -2.854805 -0.867735
H -1.683530 0.568854 1.502492
H 1.881629 2.466203 -0.854742
H 2.973995 2.666940 0.549779
H 3.640919 2.170932 -1.020775
H 4.653589 -0.015434 0.099717
H 3.577749 -1.093546 1.031753
H 4.001573 0.525427 1.660036
H -3.947957 0.132265 -0.598260
H -3.939457 1.263398 0.817210


